CID 11286907

Tert-butyl n-[1-(hydroxymethyl)cyclopropyl]carbamate

Structural Information

Molecular Formula
C9H17NO3
SMILES
CC(C)(C)OC(=O)NC1(CC1)CO
InChI
InChI=1S/C9H17NO3/c1-8(2,3)13-7(12)10-9(6-11)4-5-9/h11H,4-6H2,1-3H3,(H,10,12)
InChIKey
HFMAZNJKNNRONT-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(hydroxymethyl)cyclopropyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

677
Patents

187.12085 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.12813 141.8
[M+Na]+ 210.11007 149.8
[M-H]- 186.11357 145.3
[M+NH4]+ 205.15467 158.0
[M+K]+ 226.08401 148.7
[M+H-H2O]+ 170.11811 137.9
[M+HCOO]- 232.11905 162.6
[M+CH3COO]- 246.13470 183.9
[M+Na-2H]- 208.09552 148.5
[M]+ 187.12030 145.7
[M]- 187.12140 145.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe