CID 233757

17593-26-9

Structural Information

Molecular Formula
C12H21NO2
SMILES
CC1=CCC(CC1)C(C)(C)OC(=O)NC
InChI
InChI=1S/C12H21NO2/c1-9-5-7-10(8-6-9)12(2,3)15-11(14)13-4/h5,10H,6-8H2,1-4H3,(H,13,14)
InChIKey
SVCWPSWTLKIBPU-UHFFFAOYSA-N
Compound name
2-(4-methylcyclohex-3-en-1-yl)propan-2-yl N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

211.15723 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.164506 150.0
[M+Na]+ 234.146448 154.8
[M-H]- 210.149954 153.1
[M+NH4]+ 229.191053 168.8
[M+K]+ 250.120388 153.9
[M+H-H2O]+ 194.154490 144.4
[M+HCOO]- 256.155431 169.9
[M+CH3COO]- 270.171081 190.1
[M+Na-2H]- 232.131896 153.8
[M]+ 211.15668142 148.8
[M]- 211.15777858 148.8
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

No patent data available for this compound.