CID 18999455

74620-35-2

Structural Information

Molecular Formula
C34H31NO2
SMILES
CC(C)C1=CC2=C(C=C(C=C2)N(CC3=CC=CC=C3)CC4=CC=CC=C4)OC15C=CC6=CC=CC=C6O5
InChI
InChI=1S/C34H31NO2/c1-25(2)31-21-29-17-18-30(22-33(29)37-34(31)20-19-28-15-9-10-16-32(28)36-34)35(23-26-11-5-3-6-12-26)24-27-13-7-4-8-14-27/h3-22,25H,23-24H2,1-2H3
InChIKey
WMEULFXUARHGIP-UHFFFAOYSA-N
Compound name
N,N-dibenzyl-3'-propan-2-yl-2,2'-spirobi[chromene]-7'-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

485.23547 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 486.242746 225.3
[M+Na]+ 508.224688 229.3
[M-H]- 484.228194 238.8
[M+NH4]+ 503.269293 232.4
[M+K]+ 524.198628 225.2
[M+H-H2O]+ 468.232730 210.5
[M+HCOO]- 530.233671 239.5
[M+CH3COO]- 544.249321 231.9
[M+Na-2H]- 506.210136 228.6
[M]+ 485.23492142 224.8
[M]- 485.23601858 224.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe