CID 25220830

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

Structural Information

Molecular Formula
C10H19NO3
SMILES
CC(C)(C)OC(=O)NC1(CCC1)CO
InChI
InChI=1S/C10H19NO3/c1-9(2,3)14-8(13)11-10(7-12)5-4-6-10/h12H,4-7H2,1-3H3,(H,11,13)
InChIKey
CLRGYDRXIYIAHC-UHFFFAOYSA-N
Compound name
tert-butyl N-[1-(hydroxymethyl)cyclobutyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

149
Patents

201.13649 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.14377 149.8
[M+Na]+ 224.12571 153.4
[M-H]- 200.12921 151.7
[M+NH4]+ 219.17031 163.4
[M+K]+ 240.09965 156.1
[M+H-H2O]+ 184.13375 140.5
[M+HCOO]- 246.13469 168.2
[M+CH3COO]- 260.15034 186.5
[M+Na-2H]- 222.11116 154.5
[M]+ 201.13594 158.0
[M]- 201.13704 158.0
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