CID 2794277

352235-99-5

Structural Information

Molecular Formula
C19H22N2O2
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCCCN
InChI
InChI=1S/C19H22N2O2/c20-11-5-6-12-21-19(22)23-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18H,5-6,11-13,20H2,(H,21,22)
InChIKey
GUERCAXBAHLNFO-UHFFFAOYSA-N
Compound name
9H-fluoren-9-ylmethyl N-(4-aminobutyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

105
Patents

310.16812 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.17540 172.9
[M+Na]+ 333.15734 178.6
[M-H]- 309.16084 177.3
[M+NH4]+ 328.20194 190.7
[M+K]+ 349.13128 173.7
[M+H-H2O]+ 293.16538 165.5
[M+HCOO]- 355.16632 195.5
[M+CH3COO]- 369.18197 210.8
[M+Na-2H]- 331.14279 176.9
[M]+ 310.16757 174.3
[M]- 310.16867 174.3
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