CID 88171806

Tert-butyl n-(1-formylcyclopropyl)-n-methylcarbamate

Structural Information

Molecular Formula
C10H17NO3
SMILES
CC(C)(C)OC(=O)N(C)C1(CC1)C=O
InChI
InChI=1S/C10H17NO3/c1-9(2,3)14-8(13)11(4)10(7-12)5-6-10/h7H,5-6H2,1-4H3
InChIKey
DGKXCTZLDVTPPL-UHFFFAOYSA-N
Compound name
tert-butyl N-(1-formylcyclopropyl)-N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

199.12085 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.12813 145.6
[M+Na]+ 222.11007 154.0
[M-H]- 198.11357 151.8
[M+NH4]+ 217.15467 162.6
[M+K]+ 238.08401 154.4
[M+H-H2O]+ 182.11811 141.3
[M+HCOO]- 244.11905 168.2
[M+CH3COO]- 258.13470 191.7
[M+Na-2H]- 220.09552 151.5
[M]+ 199.12030 152.1
[M]- 199.12140 152.1
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