CID 121002073

Tert-butyl 4-hydroxy-2-methoxyphenylcarbamate

Structural Information

Molecular Formula
C12H17NO4
SMILES
CC(C)(C)OC(=O)NC1=C(C=C(C=C1)O)OC
InChI
InChI=1S/C12H17NO4/c1-12(2,3)17-11(15)13-9-6-5-8(14)7-10(9)16-4/h5-7,14H,1-4H3,(H,13,15)
InChIKey
UUWWYFQJCAFFSU-UHFFFAOYSA-N
Compound name
tert-butyl N-(4-hydroxy-2-methoxyphenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

239.11575 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.12303 153.2
[M+Na]+ 262.10497 160.3
[M-H]- 238.10847 156.0
[M+NH4]+ 257.14957 170.5
[M+K]+ 278.07891 159.4
[M+H-H2O]+ 222.11301 147.5
[M+HCOO]- 284.11395 174.9
[M+CH3COO]- 298.12960 191.7
[M+Na-2H]- 260.09042 157.9
[M]+ 239.11520 156.1
[M]- 239.11630 156.1
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