CID 3077285

1-oxa-3,8-diazaspiro(4.5)decan-2-one, 4-methylene-8-(2-phenylethyl)-3-propyl-

Structural Information

Molecular Formula
C19H26N2O2
SMILES
CCCN1C(=C)C2(CCN(CC2)CCC3=CC=CC=C3)OC1=O
InChI
InChI=1S/C19H26N2O2/c1-3-12-21-16(2)19(23-18(21)22)10-14-20(15-11-19)13-9-17-7-5-4-6-8-17/h4-8H,2-3,9-15H2,1H3
InChIKey
UQBVBNUWFUOGQL-UHFFFAOYSA-N
Compound name
4-methylidene-8-(2-phenylethyl)-3-propyl-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

314.19943 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.20671 177.7
[M+Na]+ 337.18865 183.3
[M-H]- 313.19215 183.3
[M+NH4]+ 332.23325 192.1
[M+K]+ 353.16259 179.3
[M+H-H2O]+ 297.19669 168.4
[M+HCOO]- 359.19763 192.5
[M+CH3COO]- 373.21328 205.6
[M+Na-2H]- 335.17410 177.7
[M]+ 314.19888 174.7
[M]- 314.19998 174.7
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