CID 10039614

62082-27-3

Structural Information

Molecular Formula
C14H23O4P
SMILES
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)P(=O)(O)O
InChI
InChI=1S/C14H23O4P/c1-13(2,3)10-7-9(19(16,17)18)8-11(12(10)15)14(4,5)6/h7-8,15H,1-6H3,(H2,16,17,18)
InChIKey
ZRKDOSNAKOLZTN-UHFFFAOYSA-N
Compound name
(3,5-ditert-butyl-4-hydroxyphenyl)phosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

286.1334 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.140676 170.4
[M+Na]+ 309.122618 177.8
[M-H]- 285.126124 169.7
[M+NH4]+ 304.167223 185.7
[M+K]+ 325.096558 175.5
[M+H-H2O]+ 269.130660 164.2
[M+HCOO]- 331.131601 190.0
[M+CH3COO]- 345.147251 197.0
[M+Na-2H]- 307.108066 172.3
[M]+ 286.13285142 172.3
[M]- 286.13394858 172.3
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