CID 11715497

285124-33-6

Structural Information

Molecular Formula
C11H23NO3
SMILES
CC(C)[C@@H](CCO)NC(=O)OC(C)(C)C
InChI
InChI=1S/C11H23NO3/c1-8(2)9(6-7-13)12-10(14)15-11(3,4)5/h8-9,13H,6-7H2,1-5H3,(H,12,14)/t9-/m1/s1
InChIKey
HYEXCBXDBHHJJY-SECBINFHSA-N
Compound name
tert-butyl N-[(3R)-1-hydroxy-4-methylpentan-3-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

217.1678 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.17508 154.6
[M+Na]+ 240.15702 158.7
[M-H]- 216.16052 153.2
[M+NH4]+ 235.20162 172.4
[M+K]+ 256.13096 159.0
[M+H-H2O]+ 200.16506 149.7
[M+HCOO]- 262.16600 172.8
[M+CH3COO]- 276.18165 190.5
[M+Na-2H]- 238.14247 155.8
[M]+ 217.16725 156.0
[M]- 217.16835 156.0
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