CID 122163358

Tert-butyl n-[2-(3-hydroxycyclobutyl)ethyl]carbamate

Structural Information

Molecular Formula
C11H21NO3
SMILES
CC(C)(C)OC(=O)NCCC1CC(C1)O
InChI
InChI=1S/C11H21NO3/c1-11(2,3)15-10(14)12-5-4-8-6-9(13)7-8/h8-9,13H,4-7H2,1-3H3,(H,12,14)
InChIKey
KTEWHLLTEGUAAD-UHFFFAOYSA-N
Compound name
tert-butyl N-[2-(3-hydroxycyclobutyl)ethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

215.15215 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.15943 153.3
[M+Na]+ 238.14137 156.4
[M-H]- 214.14487 155.0
[M+NH4]+ 233.18597 164.6
[M+K]+ 254.11531 158.9
[M+H-H2O]+ 198.14941 142.5
[M+HCOO]- 260.15035 171.4
[M+CH3COO]- 274.16600 191.1
[M+Na-2H]- 236.12682 155.6
[M]+ 215.15160 161.8
[M]- 215.15270 161.8
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

patents stripe